cyclohexylmethanamine;hydrobromide

C7H16BrN — CID 13001131

IUPACcyclohexylmethanamine;hydrobromide
SMILESBr.NCC1CCCCC1
InChIInChI=1S/C7H15N.BrH/c8-6-7-4-2-1-3-5-7;/h7H,1-6,8H2;1H
InChIKeyLBEXWMLYXHXELS-UHFFFAOYSA-N
MW194.12 g/mol
LogP2.10
Rot. Bonds1

About cyclohexylmethanamine;hydrobromide

cyclohexylmethanamine;hydrobromide (PubChem CID 13001131) has the molecular formula C7H16BrN and a molecular weight of 194.12 g/mol. Its IUPAC name is cyclohexylmethanamine;hydrobromide.

Molecular Properties

Compound Namecyclohexylmethanamine;hydrobromide
PubChem CID13001131
Molecular FormulaC7H16BrN
Molecular Weight194.12 g/mol
Exact Mass193.05
IUPAC Namecyclohexylmethanamine;hydrobromide
SMILESBr.NCC1CCCCC1
InChIInChI=1S/C7H15N.BrH/c8-6-7-4-2-1-3-5-7;/h7H,1-6,8H2;1H
InChIKeyLBEXWMLYXHXELS-UHFFFAOYSA-N
XLogP2.10
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.12
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze cyclohexylmethanamine;hydrobromide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

cyclohexylmethanamine;hydrochloride
CID 3039618
cyclohexylmethanamine;methanol
CID 70430105
cyclohexanamine;cyclohexylmethanamine
CID 174974863
carbonic acid;cyclohexylmethanamine
CID 67545146
[4-(aminomethyl)cyclohexyl]methanamine
CID 158172497
carbonyl dichloride;cyclopentylmethanamine
CID 175500513
(5-methylcyclononyl)methanamine
CID 91548607
butane;cyclopentane;cyclopentylmethanamine;ethanamine;methane;yttrium
CID 158510673
[(1S,3S)-3-(aminomethyl)cyclohexyl]methanamine
CID 6951512
(4-cyclohexyloxycyclohexyl)methanamine
CID 83835102
(5,5-dimethylcyclononyl)methanamine
CID 129138997
N'-[[4-(aminomethyl)cyclohexyl]methyl]-N-(cyclohexylmethyl)propane-1,3-diamine
CID 70964455

Frequently Asked Questions

What is the IUPAC name of cyclohexylmethanamine;hydrobromide?
The IUPAC name of cyclohexylmethanamine;hydrobromide (CID 13001131) is cyclohexylmethanamine;hydrobromide.
What is the SMILES notation for cyclohexylmethanamine;hydrobromide?
The canonical SMILES for cyclohexylmethanamine;hydrobromide is Br.NCC1CCCCC1.
What is the InChIKey of cyclohexylmethanamine;hydrobromide?
The InChIKey is LBEXWMLYXHXELS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N.BrH/c8-6-7-4-2-1-3-5-7;/h7H,1-6,8H2;1H.
What are the key properties of cyclohexylmethanamine;hydrobromide?
cyclohexylmethanamine;hydrobromide has a molecular weight of 194.12 g/mol, XLogP of 2.10, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexylmethanamine;hydrobromide is sourced from PubChem (CID 13001131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).